N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-(cyanomethoxy)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=C(C=C2)OCC#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=C(C=C2)OCC#N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5S/c1-11-9-14(19(20)21)10-16(12(11)2)25(22,23)18-13-3-5-15(6-4-13)24-8-7-17/h3-6,9-10,18H,8H2,1-2H3